NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase

CALCULATED PROPERTIES*

Physical   Elemental   Topological  

PHYSICAL PROPERTIESLogP 10.42
Van der Waals volume 476.4
Polar Surface Area 0
Van der Waals Surface Area 791.52
Refractivity 144.62

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ELEMENTAL PROPERTIESExact Mass 410.391
Isotope Formula C30H50
Dot Disconnected Formula C30H50
Dot Disconnected Isotope Formula C30H50
Composition C (87.73%), H (12.27%)
Isotope Composition C (87.73%), H (12.27%)
Donor Sites 0
Donor Count 0
Acceptor Sites 0
Acceptor Count 0


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TOPOLOGICAL PROPERTIESAtom Count80
Aliphatic Atom Count 30
Aliphatic Bond Count 29
Aromatic Bond Count 0
Asymmetric Atom Count 0
Bond Count 79
Chain Atom Count 30
Chain Bond Count 29
Chiral Center Count 0
Ring Atom Count 0
Ring Bond Count 0
Rotatable Bond Count 15
Stereo Double Bond Count 4
Aliphatic Ring Count 0
Aromatic Ring Count 0
Carbo Ring Count 0
Carboaliphatic Ring Count 0
Carboaromatic Ring Count 0
Fused Aliphatic Ring Count 0
Fused Aromatic Ring Count 0
Fused Ring Count 0
Hetero Ring Count 0
Heteroaliphatic Ring Count 0
Heteroaromatic Ring Count 0
Largest Ring Size 0
Largest Ring System Size 0
Ring Count 0
Smallest Ring Size 0
Smallest Ring System Size 0

 






Copyright © 2012. Subhash M. Agagrwal. All Rights Reserved.